ID: 110860
SMILES:CCCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1C(=O)C(CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.3
InChIKey:ARJFMIQWWZQJEJ-UHFFFAOYSA-N
ID: 110861
SMILES:C(Cc1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC12)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.913
InChIKey:SSXGVPSEIMSGLQ-UHFFFAOYSA-N
ID: 110862
SMILES:Oc1c2c(cc(CC(C)OC)c1)OC(CCC=C(CCC=C(C)C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.715
InChIKey:PVLLYMMKRCHRIP-UHFFFAOYSA-N
ID: 110863
SMILES:Cc1cc(O)c(OC)cc1C1C(C(C)=C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.527
InChIKey:ABPHQODQYTYRRD-UHFFFAOYSA-N
ID: 110864
SMILES:C1CC2C(C)(C)Oc3c(cc(O)cc3C)C2C(=O)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.609
InChIKey:NZAIHFKRDOFFTF-UHFFFAOYSA-N
ID: 110865
SMILES:OS(=O)(Oc1cc(CCCCC)cc2c1C1C(=O)OC(C2CC(C)=O)C1(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.515
CB1 binding score: -15.078
InChIKey:VIIUJPRXCZHTRF-UHFFFAOYSA-N
ID: 110866
SMILES:CC(C)=CC(=O)CC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 330.468
CB1 binding score: -17.947
InChIKey:ZXDVFJZNEMZQLZ-UHFFFAOYSA-N
ID: 110867
SMILES:C1C(C(=CCC=C(C)C)C)c2cc(C(=O)OC)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.158
InChIKey:DQUGBTOZIAISIK-UHFFFAOYSA-N
ID: 110868
SMILES:CC(C1CCC(C)CC1c1c(O)cc(CCCCC)cc1OC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.528
CB1 binding score: -18.883
InChIKey:KKBNGEMFBFEYQN-UHFFFAOYSA-N
ID: 110869
SMILES:C(CC)CCc1cc(OC)c(O)c2c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.212
InChIKey:NCRPWEZRNAXILS-UHFFFAOYSA-N
ID: 110870
SMILES:O1C(C)(C)C1C(CC1(C)C=Cc2cc(OC)cc(C)c2O1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.768
InChIKey:TYKADNQWIHSYIP-UHFFFAOYSA-N
ID: 110871
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)c(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.677
InChIKey:YWEZXUNAYVCODW-UHFFFAOYSA-N
ID: 110872
SMILES:CC1(C)C2CC(O)C(C)=CC2c2c(ccc(O)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.086
InChIKey:HTZNOUQOHSVVAH-UHFFFAOYSA-N
ID: 110873
SMILES:c1(OC)c(O)c2c(cc1CCCCC)OC(C)(C)C1CC(=O)C(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.15
InChIKey:VRNGAHSBRMWUDO-UHFFFAOYSA-N
ID: 110874
SMILES:c1(C)cc2c(cc1)C(C)(C)Oc1c-2cc(CCCCC=C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.448
CB1 binding score: -14.481
InChIKey:UZMOWPDUKULWJB-UHFFFAOYSA-N
ID: 110875
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(OC)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.499
InChIKey:CDCJUBPCFJBDNF-UHFFFAOYSA-N
ID: 110876
SMILES:CC1(C)C2CC=C(C)CC2c2c(cc(CCCCC)cc2OC(C)=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -18.166
InChIKey:WPRGTCVOBXQUHO-UHFFFAOYSA-N
ID: 110877
SMILES:C1C(C)(C)C(CCC(C)=CCC2Cc3c(cc(=O)c(CCCCC)cc3O)OC2C)=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -18.539
InChIKey:KUTOKFDKGIBAGQ-UHFFFAOYSA-N
ID: 110878
SMILES:c1c(C2C=C(C)C(O)CC2C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 316.485
CB1 binding score: -18.334
InChIKey:JKMFOEAOXWUEFP-UHFFFAOYSA-N
ID: 110879
SMILES:C12=CC(C)CCCC1(C)Oc1cc(CCCCC)cc(OC)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.239
InChIKey:WXCVGHZNJMBMSH-UHFFFAOYSA-N
ID: 110880
SMILES:O1C2C(C)(C)C(CO)(CC2c2c(OC)cc(CCC)cc2O)CC1C=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -13.444
InChIKey:OCFZYJYMKSGCKW-UHFFFAOYSA-N